PDB: 5OCX, Crystal structure of ACPA E4 in complex with CII-C-13-CIT (311K, 38°C, 100 ns): random seed #3

Crystal structure of ACPA E4 in complex with CII-C-13-CIT (311K, 38°C, 100 ns): random seed #3. PDBs obtained every 50 ns. Contains free binding energies calculations.

ACPA E4与CII-C-13-CIT复合物的晶体结构相关数据，实验或模拟条件为311开尔文、38摄氏度、总时长100纳秒，采用随机种子#3。每50纳秒采集一次PDB（蛋白质数据库，Protein Data Bank）文件，包含自由结合能计算结果。